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1,4-Methanonaphthalene-5,8-dione, 1,2,3,4-tetrahydro-6-(octadecylamino)-
SpectraBase Compound ID 6yH0UyafJiw
InChI InChI=1S/C29H47NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-30-25-22-26(31)27-23-18-19-24(21-23)28(27)29(25)32/h22-24,30H,2-21H2,1H3/t23-,24+/m1/s1
InChIKey WRSLFSDYRUDAQI-RPWUZVMVSA-N
Mol Weight 441.7 g/mol
Molecular Formula C29H47NO2
Exact Mass 441.36068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AKsb42LKSfD
Name 1,4-Methanonaphthalene-5,8-dione, 1,2,3,4-tetrahydro-6-(octadecylamino)-
Alternate Name(s) (1R,4S)-6-(octadecylamino)-1,2,3,4-tetrahydro-1,4-methanonaphthalene-5,8-dione 6-(octadecylamino)-1,2,3,4-tetrahydro-1,4-methanonaphthalene-5,8-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H47NO2
InChI InChI=1S/C29H47NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-30-25-22-26(31)27-23-18-19-24(21-23)28(27)29(25)32/h22-24,30H,2-21H2,1H3/t23-,24+/m1/s1
InChIKey WRSLFSDYRUDAQI-RPWUZVMVSA-N
Molecular Weight 441.700 g/mol
SMILES N(CCCCCCCCCCCCCCCCCC)C1=CC(C=2[C@@]3(CC[C@@](C3)(C2C1=O)[H])[H])=O
SPLASH splash10-0006-3210900000-6fe0ac9c27aeba9249fc
Source of Spectrum JX-2015-4-501
Wiley ID 1725933